EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:141935 - Pandine

ChEBI IDCHEBI:141935
ChEBI NamePandine
Stars
Last Modified30 August 2018
Submittermwilliams
DownloadsMolfile
FormulaC21H24N2O3
Net Charge0
Average Mass352.434
Monoisotopic Mass352.17869
SMILES[H]C12C[C@]34C[C@](O)(CC)[C@H]3N1CC[C@@]21C(=C4C(=O)OC)Nc2ccccc21
InChIInChI=1S/C21H24N2O3/c1-3-20(25)11-19-10-14-21(8-9-23(14)18(19)20)12-6-4-5-7-13(12)22-16(21)15(19)17(24)26-2/h4-7,14,18,22,25H,3,8-11H2,1-2H3/t14?,18-,19+,20+,21-/m0/s1
InChIKeyRWIBVEZSMNDHAB-VQAUZTJOSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Pandine (CHEBI:141935) is a monoterpenoid indole alkaloid (CHEBI:65323)